AG003RR7

82437-64-7 | Methyl 3-amino-4-phenylthiophene-2-carboxylate

AG003RR7

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CAS Number	82437-64-7
Catalog Number	AG003RR7(AGN-PC-0KKNH8)
Chemical Name	Methyl 3-amino-4-phenylthiophene-2-carboxylate
IUPAC Name	methyl 3-amino-4-phenylthiophene-2-carboxylate
InChI	InChI=1S/C12H11NO2S/c1-15-12(14)11-10(13)9(7-16-11)8-5-3-2-4-6-8/h2-7H,13H2,1H3
InChI Key	UKWKMKNACSKDCN-UHFFFAOYSA-N
MDL Number	MFCD00206450
Molecular Formula	C12H11NO2S
Molecular Weight	233.2862
SMILES	COC(=O)C1=C(N)C(=CS1)C1=CC=CC=C1
Synonyms	methyl 3-amino-4-phenylthiophene-2-carboxylate, 82437-64-7, AK101634, 3-Amino-4-phenyl-2-thiophenecarboxylic acid methyl ester, AC1MC172, SCHEMBL1883906, CTK5E9674, DTXSID10374906, UKWKMKNACSKDCN-UHFFFAOYSA-N, KS-00003KE5, ZINC2557710, 2746AC, ANW-62816, BBL004458, MFCD00206450, SBB098105, STL125469, AKOS005726350, CM-1291, FS-1447, MCULE-3910615400, QC-9583, TRA0127230, VT20191, AJ-40065, AN-36189, 3-amino-2-methoxycarbonyl-4-phenylthiophene, AB0097857, AX8233173, DB-075843, TC-151561, FT-0742363, H2952, methyl 3-amino-4-phenyl-2-thiophenecarboxylate, methyl 3-amino-4-phenyl-thiophene-2-carboxylate, 437M647, I09-1563, methyl 3-amino-4-phenylthiophene-2-carboxylate ,98%, F6548-0422, Z1741962460, 2-Thiophenecarboxylicacid, 3-amino-4-phenyl-, methyl ester, Methyl 3-amino-4-phenylthiophene-2-carboxylate, AldrichCPR, C12H11NO2S, ZINC02557710, CID2759782, Methyl 3-amino-4-phenylthiophene-2-carboxylate, 98% - 1G 1g,

Complexity	253
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	233.051g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	233.285g/mol
Monoisotopic Mass	233.051g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	80.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

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